SCHEMBL30945852

SCHEMBL30945852

Cc1cc(=O)oc2cc(NC(=O)[C@@H](N)CC(N)=O)ccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.62
CA1 P00915 3/20 0.62
CA9 Q16790 3/20 0.62
KDM4E B2RXH2 7/20 0.59
ALDH1A1 P00352 7/20 0.59
HPGD P15428 6/20 0.59
RAB9A P51151 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
NPC1 O15118 4/20 0.59
HSD17B10 Q99714 2/20 0.59
GAA P10253 2/20 0.58
GLA P06280 1/20 0.58
TDP1 Q9NUW8 3/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
MAPT P10636 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22882708 1.00 CA12 (0.62) CA12CA1CA9KDM4EALDH1A1
SCHEMBL22882757 1.00 CA12 (0.62) CA12CA1CA9KDM4EALDH1A1
SCHEMBL22882780 0.92 CA12 (0.55) CA12CA1CA9KDM4EALDH1A1
SCHEMBL22882720 0.92 CA12 (0.55) CA12CA1CA9KDM4EALDH1A1
SCHEMBL3340356 0.91 KDM4E (0.64) CA12CA1CA9KDM4EALDH1A1
SCHEMBL29477192 0.91 KDM4E (0.64) CA12CA1CA9KDM4EALDH1A1
SCHEMBL18659351 0.89 CA12 (0.59) CA12CA1CA9KDM4EALDH1A1
SCHEMBL18659352 0.89 CA12 (0.59) CA12CA1CA9KDM4EALDH1A1
SCHEMBL29410513 0.89 CA12 (0.59) CA12CA1CA9KDM4EALDH1A1
SCHEMBL5706432 0.88 CA12 (0.62) CA12CA1CA9KDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12493042-B2 Molecules and methods for iterative polypeptide analysis and processing WASHINGTON UNIVERSITY (US) 2025-12-09 US disclosed
US-20240201199-A1 MOLECULES AND METHODS FOR ITERATIVE POLYPEPTIDE ANALYSIS AND PROCESSING WASHINGTON UNIVERSITY (US) 2024-06-20 US disclosed